1-(4-fluorophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(4-fluorophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-allyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-1-(4-fluorophenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-fluorophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-fluorophenyl)-5-[(3-methoxy-5-prop-2-enyl-4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-allyl-5-methoxy-4-propargyloxy-benzylidene)-1-(4-fluorophenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C24H19FN2O4S MolecularWeight: 450.482063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC#C)CC=C)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=CC(=C1OCC#C)CC=C)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H19FN2O4S/c1-4-6-16-12-15(14-20(30-3)21(16)31-11-5-2)13-19-22(28)26-24(32)27(23(19)29)18-9-7-17(25)8-10-18/h2,4,7-10,12-14H,1,6,11H2,3H3,(H,26,28,32)